tert-butyl (1R,5S)-3-(1-phenylethoxy)-8-azabicyclo[3.2.1]octane-8-carboxylate

Systemtic Name: tert-butyl (1R,5S)-3-(1-phenylethoxy)-8-azabicyclo[3.2.1]octane-8-carboxylate Openeye Name: tert-butyl (1R,5S)-3-(1-phenylethoxy)-8-azabicyclo[3.2.1]octane-8-carboxylate CAS Name: (1R,5S)-3-(1-phenylethoxy)-8-azabicyclo[3.2.1]octane-8-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1R,5S)-3-(1-phenylethoxy)-8-azabicyclo[3.2.1]octane-8-carboxylate Traditional Name: (1R,5S)-3-(1-phenylethoxy)-8-azabicyclo[3.2.1]octane-8-carboxylic acid tert-butyl ester Formula: C20H29NO3 MolecularWeight: 331.44916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC2CC3CCC(C2)N3C(=O)OC(C)(C)C

Isomeric SMILES

CC(C1=CC=CC=C1)OC2C[C@H]3CC[C@@H](C2)N3C(=O)OC(C)(C)C

InChI

InChI=1S/C20H29NO3/c1-14(15-8-6-5-7-9-15)23-18-12-16-10-11-17(13-18)21(16)19(22)24-20(2,3)4/h5-9,14,16-18H,10-13H2,1-4H3/t14?,16-,17+,18?